tert-butyl 4-(3-cyanophenyl)-3-ethyl-5-methanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 4-(3-cyanophenyl)-3-ethyl-5-methanoyl-1H-pyrrole-2-carboxylate Openeye Name: tert-butyl 4-(3-cyanophenyl)-3-ethyl-5-formyl-1H-pyrrole-2-carboxylate CAS Name: 4-(3-cyanophenyl)-3-ethyl-5-formyl-1H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-cyanophenyl)-3-ethyl-5-formyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(3-cyanophenyl)-3-ethyl-5-formyl-1H-pyrrole-2-carboxylic acid tert-butyl ester Formula: C19H20N2O3 MolecularWeight: 324.3737

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C2=CC=CC(=C2)C#N)C=O)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(NC(=C1C2=CC=CC(=C2)C#N)C=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H20N2O3/c1-5-14-16(13-8-6-7-12(9-13)10-20)15(11-22)21-17(14)18(23)24-19(2,3)4/h6-9,11,21H,5H2,1-4H3